ChemSpider 2D Image | Methyl 2-O-[(benzyloxy)(hydroxy)phosphoryl]-3-deoxy-3-[(4-methylbenzoyl)amino]-1-thio-beta-D-galactopyranoside | C22H28NO8PS

Methyl 2-O-[(benzyloxy)(hydroxy)phosphoryl]-3-deoxy-3-[(4-methylbenzoyl)amino]-1-thio-β-D-galactopyranoside

  • Molecular FormulaC22H28NO8PS
  • Average mass497.498 Da
  • Monoisotopic mass497.127319 Da
  • ChemSpider ID25033699

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-O-[(Benzyloxy)(hydroxy)phosphoryl]-3-désoxy-3-[(4-méthylbenzoyl)amino]-1-thio-β-D-galactopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 2-O-[(benzyloxy)(hydroxy)phosphoryl]-3-deoxy-3-[(4-methylbenzoyl)amino]-1-thio-β-D-galactopyranoside [ACD/IUPAC Name]
Methyl 2-O-[(S)-(Benzyloxy)(Hydroxy)phosphoryl]-3-Deoxy-3-{[(4-Methylphenyl)carbonyl]amino}-1-Thio-β-D-Galactopyranoside
Methyl-2-O-[(benzyloxy)(hydroxy)phosphoryl]-3-desoxy-3-[(4-methylbenzoyl)amino]-1-thio-β-D-galactopyranosid [German] [ACD/IUPAC Name]
β-D-Galactopyranoside, methyl 3-deoxy-2-O-[hydroxy(phenylmethoxy)phosphinyl]-3-[(4-methylbenzoyl)amino]-1-thio- [ACD/Index Name]
PGZ

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.624
Molar Refractivity: 124.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.39
ACD/LogD (pH 5.5): -2.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 170 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 67.4±5.0 dyne/cm
Molar Volume: 351.1±5.0 cm3

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